4-[(2-hydroxyphenyl)amino]-3,5-dinitro-benzoate

Systemtic Name: 4-[(2-hydroxyphenyl)amino]-3,5-dinitro-benzoate Openeye Name: 4-(2-hydroxyanilino)-3,5-dinitro-benzoate CAS Name: 4-(2-hydroxyanilino)-3,5-dinitrobenzoate IUPAC Name: 4-(2-hydroxyanilino)-3,5-dinitrobenzoate Traditional Name: 4-(2-hydroxyanilino)-3,5-dinitro-benzoate Formula: C13H8N3O7- MolecularWeight: 318.21852

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Descriptors Computed from Structure

Canonical SMILES:

C1=CC=C(C(=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)[O-])[N+](=O)[O-])O

Isomeric SMILES

C1=CC=C(C(=C1)NC2=C(C=C(C=C2[N+](=O)[O-])C(=O)[O-])[N+](=O)[O-])O

InChI

InChI=1S/C13H9N3O7/c17-11-4-2-1-3-8(11)14-12-9(15(20)21)5-7(13(18)19)6-10(12)16(22)23/h1-6,14,17H,(H,18,19)/p-1